PDB ligand accession: 90B
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QPHLKSOMHMCVPZ-UHFFFAOYSA-N
SMILES: Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(cc(c3)Br)C(=O)NC4CCNCC4)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5NKE | Download | Experimental | e5nkeA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |